SCHEMBL8349189

SCHEMBL8349189

CCN1CCN(c2cccc3ccc(OC)cc23)CC1C1CCc2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1B P49286 1/20 0.46
HTR1A P08908 5/20 0.44
HTR1D P28221 1/20 0.44
HTR1B P28222 1/20 0.44
SIGMAR1 Q99720 3/20 0.41
DRD1 P21728 2/20 0.39
SRD5A1 P18405 2/20 0.39
ADRB2 P07550 1/20 0.38
ADRB1 P08588 1/20 0.38
ADRA2A P08913 1/20 0.38
DRD2 P14416 1/20 0.38
ADRA2B P18089 1/20 0.38
ADRA2C P18825 1/20 0.38
DRD4 P21917 1/20 0.38
SLC6A2 P23975 1/20 0.38
HRH2 P25021 1/20 0.38
ADRA1D P25100 1/20 0.38
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
SLC6A4 P31645 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8346433 0.94 MTNR1B (0.47) MTNR1BHTR1AHTR1DHTR1BSIGMAR1
SCHEMBL8344546 0.75 SIGMAR1 (0.53) MTNR1BHTR1AHTR1DHTR1BSIGMAR1
SCHEMBL8344544 0.73 MTNR1B (0.43) MTNR1BHTR1AHTR1DHTR1BSIGMAR1
SCHEMBL8349457 0.73 MTNR1B (0.52) MTNR1BHTR1AHTR1DHTR1B
SCHEMBL8347285 0.73 MTNR1B (0.61) MTNR1BHTR1AHTR1DHTR1B
SCHEMBL27529224 0.73 MTNR1B (0.61) MTNR1BHTR1AHTR1DHTR1B
SCHEMBL8344543 0.72 MTNR1B (0.43) MTNR1BHTR1AHTR1DHTR1BSIGMAR1
SCHEMBL8343954 0.70 SIGMAR1 (0.58) MTNR1BHTR1AHTR1DHTR1BSIGMAR1
SCHEMBL6000211 0.69 HTR1A (0.75) MTNR1BHTR1AHTR1DHTR1BSIGMAR1
SCHEMBL8349455 0.69 MTNR1B (0.53) MTNR1BHTR1AHTR1DHTR1BDRD1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5929078-A ANTISEROTONINE AGENT SYNTHELABO (FR) 1999-07-27 US claimed